@MOLECULE linezolid 44 46 0 0 0 SMALL USER_CHARGES @ATOM 1 F -2.9596 2.2055 0.2301 F 1 UNL11111111 -0.1425 2 O 3.3845 1.0517 -0.5643 O.3 1 UNL11111111 -0.3878 3 O -6.9877 -0.9442 0.3821 O.3 1 UNL11111111 -0.3881 4 O 1.6755 2.5114 -0.4880 O.2 1 UNL11111111 -0.4435 5 O 6.6486 -1.9057 0.1375 O.2 1 UNL11111111 -0.5411 6 N 1.3039 0.1921 -0.3766 N.am 1 UNL11111111 -0.5027 7 N -4.3307 -0.1413 -0.0655 N.pl3 1 UNL11111111 -0.3876 8 N 5.6844 0.0306 0.7809 N.am 1 UNL11111111 -0.6006 9 C 3.5911 -0.3648 -0.4504 C.3 1 UNL11111111 0.0598 10 C 2.1775 -0.9928 -0.4346 C.3 1 UNL11111111 -0.1204 11 C -4.8917 -0.1462 1.3096 C.3 1 UNL11111111 -0.1459 12 C -4.9340 -1.2285 -0.8723 C.3 1 UNL11111111 -0.1530 13 C -0.0920 0.0930 -0.2711 C.ar 1 UNL11111111 0.2604 14 C 4.3683 -0.5945 0.8583 C.3 1 UNL11111111 -0.1015 15 C -2.9031 -0.1328 -0.0748 C.ar 1 UNL11111111 0.0382 16 C -6.4117 0.0708 1.1843 C.3 1 UNL11111111 -0.0429 17 C -6.4507 -0.9588 -0.9275 C.3 1 UNL11111111 -0.0411 18 C 2.0497 1.3725 -0.4764 C.2 1 UNL11111111 0.7073 19 C -0.8682 1.2443 -0.0580 C.ar 1 UNL11111111 -0.2933 20 C -0.7175 -1.1603 -0.3652 C.ar 1 UNL11111111 -0.2635 21 C -2.2463 1.1104 0.0331 C.ar 1 UNL11111111 0.2161 22 C -2.1010 -1.2618 -0.2631 C.ar 1 UNL11111111 -0.1457 23 C 6.7698 -0.7159 0.3466 C.2 1 UNL11111111 0.6104 24 C 8.0623 0.0337 0.2054 C.3 1 UNL11111111 -0.5300 25 H 4.1871 -0.6388 -1.3456 H 1 UNL11111111 0.1675 26 H 1.9831 -1.5904 -1.3513 H 1 UNL11111111 0.1610 27 H 2.0095 -1.6517 0.4434 H 1 UNL11111111 0.1615 28 H -4.4347 0.6775 1.8975 H 1 UNL11111111 0.1533 29 H -4.6812 -1.0943 1.8476 H 1 UNL11111111 0.1287 30 H -4.7493 -2.2394 -0.4513 H 1 UNL11111111 0.1266 31 H -4.5006 -1.1982 -1.8946 H 1 UNL11111111 0.1501 32 H 4.4790 -1.6922 1.0469 H 1 UNL11111111 0.1803 33 H 3.8117 -0.1643 1.7232 H 1 UNL11111111 0.1579 34 H -6.9283 -0.0533 2.1514 H 1 UNL11111111 0.1383 35 H -6.6441 1.0616 0.7537 H 1 UNL11111111 0.1360 36 H -6.6740 -0.0028 -1.4343 H 1 UNL11111111 0.1356 37 H -6.9993 -1.7838 -1.4130 H 1 UNL11111111 0.1369 38 H -0.4068 2.2339 0.0235 H 1 UNL11111111 0.2171 39 H -0.1387 -2.0654 -0.5245 H 1 UNL11111111 0.1639 40 H -2.5628 -2.2473 -0.3335 H 1 UNL11111111 0.1605 41 H 5.7095 1.0366 0.8303 H 1 UNL11111111 0.3204 42 H 8.8737 -0.6606 -0.0712 H 1 UNL11111111 0.1892 43 H 8.0096 0.8001 -0.5796 H 1 UNL11111111 0.1770 44 H 8.3606 0.5235 1.1423 H 1 UNL11111111 0.1772 @BOND 1 31 12 1 2 36 17 1 3 37 17 1 4 26 10 1 5 25 9 1 6 17 12 1 7 17 3 1 8 12 30 1 9 12 7 1 10 43 24 1 11 2 18 1 12 2 9 1 13 39 20 1 14 4 18 2 15 18 6 am 16 9 10 1 17 9 14 1 18 10 6 1 19 10 27 1 20 6 13 1 21 20 13 ar 22 20 22 ar 23 40 22 1 24 13 19 ar 25 22 15 ar 26 15 7 1 27 15 21 ar 28 42 24 1 29 7 11 1 30 19 38 1 31 19 21 ar 32 21 1 1 33 5 23 2 34 24 23 1 35 24 44 1 36 23 8 am 37 3 16 1 38 35 16 1 39 8 41 1 40 8 14 1 41 14 32 1 42 14 33 1 43 16 11 1 44 16 34 1 45 11 29 1 46 11 28 1